2-[(5-fluoranyl-2-methoxy-phenyl)methylsulfanyl]benzoic acid

Systemtic Name: 2-[(5-fluoranyl-2-methoxy-phenyl)methylsulfanyl]benzoic acid Openeye Name: 2-[(5-fluoro-2-methoxy-phenyl)methylsulfanyl]benzoic acid CAS Name: 2-[(5-fluoro-2-methoxyphenyl)methylthio]benzoic acid IUPAC Name: 2-[(5-fluoro-2-methoxyphenyl)methylsulfanyl]benzoic acid Traditional Name: 2-[(5-fluoro-2-methoxy-benzyl)thio]benzoic acid Formula: C15H13FO3S MolecularWeight: 292.325323

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)F)CSC2=CC=CC=C2C(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)F)CSC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C15H13FO3S/c1-19-13-7-6-11(16)8-10(13)9-20-14-5-3-2-4-12(14)15(17)18/h2-8H,9H2,1H3,(H,17,18)